(2S)-1-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2-keto-6-methyl-1,3-dihydrobenzimidazol-5-yl)sulfonyl]proline Formula: C13H15N3O5S MolecularWeight: 325.3403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)N3CCCC3C(=O)O)NC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)N3CCC[C@H]3C(=O)O)NC(=O)N2

InChI

InChI=1S/C13H15N3O5S/c1-7-5-8-9(15-13(19)14-8)6-11(7)22(20,21)16-4-2-3-10(16)12(17)18/h5-6,10H,2-4H2,1H3,(H,17,18)(H2,14,15,19)/t10-/m0/s1